%chk=000254977.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254977

0 1
O 3.892522 -0.601323 -0.174770
O 3.669192 1.616880 -0.425731
N -1.810008 1.569848 0.024160
C -0.631346 0.786677 -0.077314
C -1.001851 -0.597989 -0.119121
C -2.446679 -0.655518 -0.041775
C -2.915706 0.701662 0.046020
C 0.714325 1.215055 -0.134575
C 1.683639 0.204871 -0.229059
C -0.004268 -1.576688 -0.217586
C 1.318087 -1.167518 -0.269783
C -3.373492 -1.704486 -0.038032
C -4.285503 1.005465 0.136041
C 1.009644 2.672331 -0.087194
C -4.727521 -1.400885 0.051017
C -5.173244 -0.062595 0.136725
C 3.125351 0.538459 -0.292235
C 5.350989 -0.418707 -0.230772
C 5.895645 -1.817106 -0.035648
H -1.836722 2.568918 0.072453
H -0.271672 -2.630070 -0.250716
H 2.116360 -1.913478 -0.342818
H -3.030166 -2.735278 -0.104029
H -4.630917 2.031129 0.201887
H 0.719138 3.111525 0.877219
H 2.087574 2.899021 -0.217612
H 0.491490 3.219081 -0.886767
H -5.463833 -2.201695 0.055416
H -6.244615 0.129852 0.204990
H 5.594226 0.019482 -1.213848
H 5.633111 0.283337 0.572786
H 6.992001 -1.820351 -0.044203
H 5.562371 -2.246606 0.919433
H 5.547878 -2.497301 -0.825159


%chk=000254977-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254977

0 1
O 3.943390 -0.670128 -0.176192
O 3.684083 1.631709 -0.151904
N -1.807864 1.542255 -0.032916
C -0.645260 0.749537 -0.059757
C -1.040670 -0.629705 -0.048725
C -2.496099 -0.657693 -0.014186
C -2.939131 0.712615 -0.005286
C 0.698200 1.196576 -0.091669
C 1.691358 0.166355 -0.113386
C -0.032981 -1.623036 -0.071412
C 1.309008 -1.218602 -0.103263
C -3.456263 -1.697768 0.009795
C -4.307757 1.054886 0.026563
C 0.951436 2.694652 -0.099772
C -4.825703 -1.363113 0.041700
C -5.243649 -0.001162 0.049844
C 3.150041 0.489406 -0.147471
C 5.416745 -0.441019 -0.212811
C 6.074675 -1.817189 -0.240294
H -1.820889 2.559219 -0.032274
H -0.289502 -2.687438 -0.064344
H 2.106109 -1.964220 -0.121436
H -3.142250 -2.747400 0.003817
H -4.639480 2.098864 0.033048
H 0.536531 3.163627 0.815271
H 2.023031 2.924990 -0.146642
H 0.453418 3.167668 -0.969986
H -5.580810 -2.156136 0.060545
H -6.314207 0.231341 0.074818
H 5.655067 0.161225 -1.108373
H 5.701809 0.147620 0.678194
H 7.174005 -1.704708 -0.267852
H 5.807961 -2.400343 0.657850
H 5.761650 -2.386886 -1.132097


